2H-pyrido[1,2-a]quinoxaline-3-carboxamide

C13H11N3O — CID 123210452

IUPAC2H-pyrido[1,2-a]quinoxaline-3-carboxamide
SMILESNC(=O)C1=CC2=NC=C3C=CC=CN3C2=CC1
InChIInChI=1S/C13H11N3O/c14-13(17)9-4-5-12-11(7-9)15-8-10-3-1-2-6-16(10)12/h1-3,5-8H,4H2,(H2,14,17)
InChIKeyNSVSYQSKOOSKBF-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.37
Rot. Bonds1

About 2H-pyrido[1,2-a]quinoxaline-3-carboxamide

2H-pyrido[1,2-a]quinoxaline-3-carboxamide (PubChem CID 123210452) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 2H-pyrido[1,2-a]quinoxaline-3-carboxamide.

Molecular Properties

Compound Name2H-pyrido[1,2-a]quinoxaline-3-carboxamide
PubChem CID123210452
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name2H-pyrido[1,2-a]quinoxaline-3-carboxamide
SMILESNC(=O)C1=CC2=NC=C3C=CC=CN3C2=CC1
InChIInChI=1S/C13H11N3O/c14-13(17)9-4-5-12-11(7-9)15-8-10-3-1-2-6-16(10)12/h1-3,5-8H,4H2,(H2,14,17)
InChIKeyNSVSYQSKOOSKBF-UHFFFAOYSA-N
XLogP1.37
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2H-pyrido[1,2-a]quinoxaline-3-carboxamide?
The IUPAC name of 2H-pyrido[1,2-a]quinoxaline-3-carboxamide (CID 123210452) is 2H-pyrido[1,2-a]quinoxaline-3-carboxamide.
What is the SMILES notation for 2H-pyrido[1,2-a]quinoxaline-3-carboxamide?
The canonical SMILES for 2H-pyrido[1,2-a]quinoxaline-3-carboxamide is NC(=O)C1=CC2=NC=C3C=CC=CN3C2=CC1.
What is the InChIKey of 2H-pyrido[1,2-a]quinoxaline-3-carboxamide?
The InChIKey is NSVSYQSKOOSKBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c14-13(17)9-4-5-12-11(7-9)15-8-10-3-1-2-6-16(10)12/h1-3,5-8H,4H2,(H2,14,17).
What are the key properties of 2H-pyrido[1,2-a]quinoxaline-3-carboxamide?
2H-pyrido[1,2-a]quinoxaline-3-carboxamide has a molecular weight of 225.25 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyrido[1,2-a]quinoxaline-3-carboxamide is sourced from PubChem (CID 123210452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).